AH13178

717907-75-0 | N-[3-[[[2-[(2,3-Dihydro-2-oxo-1h-indol-5-yl)amino]-5-(trifluoromethyl)-4-pyrimidinyl]amino]methyl]-2-pyridinyl]-n-methyl-methanesulfonamide

Manufacturer: A2B Chem

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CatalogNumber

AH13178

ChemicalName

N-[3-[[[2-[(2,3-Dihydro-2-oxo-1h-indol-5-yl)amino]-5-(trifluoromethyl)-4-pyrimidinyl]amino]methyl]-2-pyridinyl]-n-methyl-methanesulfonamide

CasNumber

717907-75-0

MolecularFormula

C21H20F3N7O3S

MolecularWeight

507.4888

MdlNumber

MFCD16038299

Smiles

O=C1Nc2c(C1)cc(cc2)Nc1ncc(c(n1)NCc1cccnc1N(S(=O)(=O)C)C)C(F)(F)F

Complexity

856

Covalently-bondedUnitCount

1

HeavyAtomCount

35

HydrogenBondAcceptorCount

12

HydrogenBondDonorCount

3

RotatableBondCount

7

Xlogp3

2

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A2B Chem

AH13178

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CatalogNumber:
AH13178

ChemicalName:
N-[3-[[[2-[(2,3-Dihydro-2-oxo-1h-indol-5-yl)amino]-5-(trifluoromethyl)-4-pyrimidinyl]amino]methyl]-2-pyridinyl]-n-methyl-methanesulfonamide

CasNumber:
717907-75-0

MolecularFormula:
C21H20F3N7O3S

MolecularWeight:
507.4888

MdlNumber:
MFCD16038299

Smiles:
O=C1Nc2c(C1)cc(cc2)Nc1ncc(c(n1)NCc1cccnc1N(S(=O)(=O)C)C)C(F)(F)F

Complexity:
856

Covalently-bondedUnitCount:
1

HeavyAtomCount:
35

HydrogenBondAcceptorCount:
12

HydrogenBondDonorCount:
3

RotatableBondCount:
7

Xlogp3:
2

Img

A2B Chem

AH13179

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CatalogNumber:
AH13179

ChemicalName:
VX-702

CasNumber:
745833-23-2

MolecularFormula:
C19H12F4N4O2

MolecularWeight:
404.3178

MdlNumber:
MFCD11616590

Smiles:
Fc1ccc(c(c1)F)c1nc(ccc1C(=O)N)N(c1c(F)cccc1F)C(=O)N

Complexity:
603

Covalently-bondedUnitCount:
1

HeavyAtomCount:
29

HydrogenBondAcceptorCount:
7

HydrogenBondDonorCount:
2

RotatableBondCount:
4

Xlogp3:
2.5

Img

A2B Chem

AH13180

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
CSc1nc(Cl)c2c(n1)nc[nH]2

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__

Img

A2B Chem

AH13181

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CatalogNumber:
AH13181

ChemicalName:
CYC-116

CasNumber:
693228-63-6

MolecularFormula:
C18H20N6OS

MolecularWeight:
368.456

MdlNumber:
MFCD14155805

Smiles:
Nc1nc(c(s1)c1ccnc(n1)Nc1ccc(cc1)N1CCOCC1)C

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__